SCHEMBL11930757

SCHEMBL11930757

CC(C)N(Cc1nccn1CC(N)=O)Cc1nccn1CC(N)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.38
FPR2 P25090 3/20 0.38
ALPG P10696 2/20 0.36
PLAA Q9Y263 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA3 P07451 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA13 Q8N1Q1 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
ALPL P05186 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19033087 0.95 LMNA (0.36) LMNAFPR2ALPGPLAACA12
SCHEMBL10260904 0.87 LMNA (0.39) LMNAFPR2ALPGPLAACA12
SCHEMBL10261857 0.87 FPR2 (0.45) LMNAFPR2ALPGPLAAALPL
SCHEMBL11936765 0.83 RAB9A (0.39) LMNAFPR2ALPGPLAACA12
SCHEMBL10261285 0.83 ALPG (0.35) LMNAFPR2ALPGPLAACA12
SCHEMBL13764517 0.77 LMNA (0.39) LMNAFPR2SMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL11930756 0.77 LMNA (0.39) LMNASMN1; SMN2ALDH1A1L3MBTL1OPRK1
SCHEMBL13310652 0.74 ALPG (0.39) FPR2ALPGPLAACA12CA1
SCHEMBL19033089 0.72 ALDH1A1 (0.37) LMNASMN1; SMN2ALDH1A1L3MBTL1TSHR
SCHEMBL10261291 0.72 LMNA (0.48) LMNASMN1; SMN2ALDH1A1L3MBTL1TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2648766-B1 PSMA-TARGETED DENDRIMERS MOLECULAR INSIGHT PHARM INC (US) 2018-04-18 EP disclosed
US-8211401-B2 Technetium- and rhenium-bis(heteroaryl) complexes and methods of use thereof for inhibiting PSMA MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2012-07-03 US disclosed
US-8211401-B2 Technetium- and rhenium-bis(heteroaryl) complexes and methods of use thereof for inhibiting PSMA MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2012-07-03 US disclosed